Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010161
PROPERTIES
| NPAID | NPA010161 |
|---|---|
| CLUSTER ID | 4107 |
| NODE ID | 3049 |
| NAME | (4R*, 5S*, 6S*, 8S*, 13R*)‐1‐(2,8‐dihydroxy‐1,2,6‐trimethyl‐1,2,6,7,8,8a‐hexahydro‐naphthalen‐1‐yl)‐3‐methoxy‐propan‐1‐one |
| FORMULA | C17H26O4 |
| MOLECULAR WEIGHT (Da) | 294.3910 |
| ACCURATE MASS (Da) | 294.1831 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sterilia |
| InChIKey | GOIFPEJPOWNBLP-FAWFFBBMSA-N |
| InChI | InChI=1S/C17H26O4/c1-11-9-12-5-7-16(2,20)17(3,14(19)6-8-21-4)15(12)13(18)10-11/h5,7,9,11,13,15,18,20H,6,8,10H2,1-4H3/t11-,13+,15-,16-,17-/m1/s1 |
| SMILES | C[C@H]1C[C@@H]([C@H]2C(=C1)C=C[C@@]([C@]2(C)C(=O)CCOC)(C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hao, Gao; Qing-Hua, Zhang; Miao-Miao, Jiang; Jin-Shan, Tang; Cheng-Du, Miao; Kui, Hong; Michio, Namikoshi; Nai-Li, Wang; Xin-Sheng, Yao Polyketides from a marine sponge-derived fungus Mycelia sterilia and proton-proton long-range coupling Magnetic Resonance in Chemistry 2008 46 (12) 1148-1152. | ||
|---|---|---|---|
| DOI | 10.1002/mrc.2338 | PMID | 18846583 |
